SCHEMBL25819048

SCHEMBL25819048

CCC(=O)c1csc(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 6/20 0.40
DAO P14920 2/20 0.40
CA2 P00918 3/20 0.39
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MAPK1 P28482 1/20 0.36
RAB9A P51151 1/20 0.36
ATM Q13315 1/20 0.36
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
PTGS1 P23219 1/20 0.35
DRD3 P35462 1/20 0.35
KMT2A Q03164 1/20 0.35
BRD4 O60885 1/20 0.35
BAZ2B Q9UIF8 1/20 0.35
BAZ2A Q9UIF9 1/20 0.35
ESR1 P03372 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10511018 0.78 DAO (0.61) GSK3BDAOCA2SMN1; SMN2L3MBTL1
SCHEMBL1820040 0.77
SCHEMBL27682287 0.76 CES2 (0.39) GSK3BDAOCA2RAB9A
SCHEMBL10513627 0.76 DAO (0.59) GSK3BDAOCA2MAPTSMN1; SMN2
SCHEMBL7217724 0.76 L3MBTL1 (0.48) DAOMAPTSMN1; SMN2L3MBTL1MAPK1
SCHEMBL938203 0.76 CA12 (0.50) DAOCA2MAPTRAB9AMEN1
SCHEMBL568600 0.74
Hydrochloric Acid SCHEMBL9626058 0.72 DAO (0.54) DAOCA2MAPTSMN1; SMN2MAPK1
SCHEMBL2181763 0.72
SCHEMBL1674356 0.72

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF SANOFI (FR) 2023-07-13 US disclosed
CN-1214022-C Vitamin D analogues GALDERMA RES & DEV (FR) 2005-08-10 CN disclosed
CN-1423645-A Vitamin D analogues GALDERMA RES & DEV (FR) 2003-06-11 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF RIPK1, RIPK4, RIPK2 GSK3B 479/4885DAO 2742/4885CA2 3285/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.